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(1S,4aS,9aS)-4a,9a-Dihydro-1,8,9a-trihydroxy-4-methoxy-4a,6-dimethyl-1H-xanthene-2,9-dione

CAS Registry Number®

1266115-29-0
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CAS Name

(1S,4aS,9aS)-4a,9a-Dihydro-1,8,9a-trihydroxy-4-methoxy-4a,6-dimethyl-1H-xanthene-2,9-dione

Molecular Formula

C16H16O7

Molecular Mass

320.29

Cite this Page

(1S,4aS,9aS)-4a,9a-Dihydro-1,8,9a-trihydroxy-4-methoxy-4a,6-dimethyl-1H-xanthene-2,9-dione.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=1266115-29-0 (retrieved 2024-09-20) (CAS RN: 1266115-29-0).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    236-238 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C16H16O7/c1-7-4-8(17)12-10(5-7)23-15(2)11(22-3)6-9(18)13(19)16(15,21)14(12)20/h4-6,13,17,19,21H,1-3H3/t13-,15-,16-/m1/s1

InChIKey

InChIKey=SIUXYUWNLUKHJD-FVQBIDKESA-N

SMILES

O[C@]12[C@@](C)(C(OC)=CC(=O)[C@H]1O)OC=3C(C2=O)=C(O)C=C(C)C3

Canonical SMILES

O=C1C=C(OC)C2(OC3=CC(=CC(O)=C3C(=O)C2(O)C1O)C)C

Other Names for this Substance

  • 1H-Xanthene-2,9-dione, 4a,9a-dihydro-1,8,9a-trihydroxy-4-methoxy-4a,6-dimethyl-, (1S,4aS,9aS)-
  • (1S,4aS,9aS)-4a,9a-Dihydro-1,8,9a-trihydroxy-4-methoxy-4a,6-dimethyl-1H-xanthene-2,9-dione
  • Microdiplodiasolol